Attributes
UniProt ID
Protein Name
Aldehyde dehydrogenase family protein
Ligand Name
1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
BOPGDPNILDQYTO-NNYOXOHSSA-N
SMILES
c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=CCC(=C5)C(=O)N)O)O)O)O)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 7JSO
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Color Legend
Unassigned regionsLigand / hetero atomse7jsoA1e7jsoA2e7jsoB1e7jsoB2e7jsoC1e7jsoC2e7jsoD1e7jsoD2e7jsoE1e7jsoE2e7jsoF1e7jsoF2e7jsoG1e7jsoG2e7jsoH1e7jsoH2
ECOD domains from experimental PDB structures interacting with ligand DB00157
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoA1 | A:3-269 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoA2 | A:270-497 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoB1 | B:3-269 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoB2 | B:270-497 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoC1 | C:270-497 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoC2 | C:3-269 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoD1 | D:270-497 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoD2 | D:3-269 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoE1 | E:270-497 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoE2 | E:3-269 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoF1 | F:3-269 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoF2 | F:270-497 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoG1 | G:270-497 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoG2 | G:3-269 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoH1 | H:3-269 |
| Q88BC5 | DB00157 | NAI | 7jso | e7jsoH2 | H:270-497 |